Glycoside
GD091898
Name:
NoneFormula:
C19H20O6N6Smiles:
C[C@@H]1Oc2ccc(Nc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2NC1=OAglycone:
CC1Oc2ccc(Nc3ncnc4c3N=C[N]4)cc2NC1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | -0.1 | Num_rotatable_bonds: | 4 |
| MolWt: | 428.41 | Num_heavy_atoms: | 31 |
| TPSA: | 163.88 | NumAromaticRings: | 3 |
Unique Aglycone
AD40088
Formula: C14H11O2N6
Smiles:
CC1Oc2ccc(Nc3ncnc4c3N=C[N]4)cc2NC1=O| HBA: | 8 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.85 | Num_rotatable_bonds: | 2 |
| MolWt: | 295.28 | Num_heavy_atoms: | 22 |
| TPSA: | 102.6 | NumAromaticRings: | 2 |
